- InChI
- InChI=1S/C14H24O5/c1-9(2)11(15)14(5,6)13(17)19-8-7-18-12(16)10(3)4/h9-10H,7-8H2,1-6H3
- InChI Key
- KHCOOLZMVDKFHC-UHFFFAOYSA-N
- Formula
- C14H24O5
- SMILES
-
CC(C)C(=O)OCCOC(=O)C(C)(C)C(=O
)C(C)C - Molecular Weight1
- 272.34
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.6908 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -1068.90 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 27.89 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.78 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 1.980 | Crippen Calculated Property | |
| McVol | 224.570 | ml/mol | McGowan Calculated Property |
| Pc | 1660.55 | kPa | Joback Calculated Property |
| Tboil | 535.40 | K | Relay (1.0) Calculated Property |
| Tc | 734.77 | K | Relay (1.0) Calculated Property |
| Tfus | 303.22 | K | Relay (1.0) Calculated Property |
| Vc | 0.838 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Standard Gibbs free energy of formation, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [635.67; 715.35] | J/mol×K | [686.12; 877.32] | 
|
| Cp,gas | 635.67 | J/mol×K | 686.12 | Joback Calculated Property |
| Cp,gas | 651.36 | J/mol×K | 717.99 | Joback Calculated Property |
| Cp,gas | 666.05 | J/mol×K | 749.85 | Joback Calculated Property |
| Cp,gas | 679.78 | J/mol×K | 781.72 | Joback Calculated Property |
| Cp,gas | 692.56 | J/mol×K | 813.59 | Joback Calculated Property |
| Cp,gas | 704.41 | J/mol×K | 845.46 | Joback Calculated Property |
| Cp,gas | 715.35 | J/mol×K | 877.32 | Joback Calculated Property |
| η | [0.0000692; 0.0039670] | Pa×s | [354.55; 686.12] |
|
| η | 0.0039670 | Pa×s | 354.55 | Joback Calculated Property |
| η | 0.0012818 | Pa×s | 409.81 | Joback Calculated Property |
| η | 0.0005417 | Pa×s | 465.07 | Joback Calculated Property |
| η | 0.0002749 | Pa×s | 520.33 | Joback Calculated Property |
| η | 0.0001589 | Pa×s | 575.60 | Joback Calculated Property |
| η | 0.0001011 | Pa×s | 630.86 | Joback Calculated Property |
| η | 0.0000692 | Pa×s | 686.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethylene glycol iso-butyrate-2,2,4-trimethyl-3-oxovalerate.
Sources
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